(S) -Rexamino

CAT: 0024-sc-477035Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-477035Size:5 mg

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CAS Number

165035-65-4

Chemical Information

(S)-Rexamino

CAS Number	165035-65-4
PubChem CID	11116360
IUPAC Name	(4S)-4-phenyl-4,5-dihydro-1,3-oxazol-2-amine
Molecular Formula	C9H10N2O
Molecular Weight	162.19
XLogP	0.9
Topological Polar Surface Area	47.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	185

SMILES

C1[C@@H](N=C(O1)N)C2=CC=CC=C2

InChI

InChI=1S/C9H10N2O/c10-9-11-8(6-12-9)7-4-2-1-3-5-7/h1-5,8H,6H2,(H2,10,11)/t8-/m1/s1

InChIKey

ZBFPLELNWIASCT-MRVPVSSYSA-N

Chemical Structure

2D Structure

CAS: 165035-65-4

CID: 11116360

Formula: C9H10N2O

MW: 162.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	162.19
XLogP3	0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	162.079312947
Monoisotopic Mass	162.079312947
Topological Polar Surface Area	47.6 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	185
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-208305	Rexamino
sc-476769	(R)-Rexamino
sc-258097	(S, S, S) -DiazaPhos-PPE
sc-215832	(S, R, S, S) -Orlistat
sc-250918A	(S, S) -Jacobsen's catalyst
sc-487380	(S, S, S) -Triglycidyl Isocyanurate
sc-250918	(S, S) -Jacobsen's catalyst
sc-471831	(S, S) -Oxaliplatin
sc-253457	(S, S) - (-) -Hydrobenzoin
sc-250916	(S, S) -DIPAMP